%chk=000255831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255831

0 1
S 0.656701 -3.264803 1.425694
N -0.987013 0.245493 1.403040
C 1.326616 -0.670665 0.967786
C 0.277290 -0.281402 1.986076
C 2.087837 0.364846 0.311261
C 3.048461 0.006953 -0.671387
C 1.574472 -1.983633 0.635676
C -1.847950 -0.824157 0.804979
C 3.258616 -1.374053 -0.986253
C 1.919143 1.753826 0.618471
C 2.540690 -2.347670 -0.343800
C -3.034602 -0.191840 0.118432
C 3.799491 1.027953 -1.335618
C 2.652861 2.715468 -0.030405
C 3.604451 2.350112 -1.025148
C -3.848503 0.718764 0.809738
C -3.339944 -0.527686 -1.208382
C -4.957205 1.286328 0.177874
C -4.453323 0.040182 -1.834973
C -5.262967 0.947094 -1.144630
H 0.037643 -1.115352 2.685683
H 0.678775 0.522821 2.652278
H -0.773226 0.946659 0.681986
H -2.208050 -1.478857 1.634312
H -1.292861 -1.488700 0.104886
H 1.200691 2.043615 1.387266
H 3.998763 -1.632116 -1.743131
H 2.701811 -3.397895 -0.584983
H 4.527402 0.732857 -2.090364
H 2.520370 3.770812 0.205846
H 4.169676 3.134323 -1.526459
H -3.602920 0.983686 1.838964
H -2.713631 -1.230620 -1.753954
H 1.431582 -4.327413 1.118257
H -5.585101 1.993464 0.716791
H -4.688551 -0.224812 -2.864025
H -6.128194 1.388119 -1.634184


%chk=000255831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255831

0 1
S 0.614432 -3.299645 1.581833
N -1.004357 0.300081 1.254487
C 1.358303 -0.640164 0.997516
C 0.218579 -0.202427 1.927640
C 2.171700 0.359353 0.333324
C 3.217215 -0.047553 -0.585715
C 1.622466 -1.996585 0.739783
C -1.735846 -0.679588 0.418855
C 3.431230 -1.445005 -0.817783
C 1.989785 1.769071 0.553768
C 2.652864 -2.399494 -0.171383
C -3.077177 -0.125972 -0.051640
C 4.019639 0.943439 -1.239179
C 2.788800 2.714815 -0.094549
C 3.812086 2.303691 -1.003754
C -3.881495 0.661228 0.812073
C -3.553251 -0.414303 -1.354839
C -5.138576 1.141552 0.382579
C -4.813575 0.060764 -1.785510
C -5.611230 0.840984 -0.917104
H -0.082105 -1.048082 2.573049
H 0.574695 0.591512 2.609196
H -0.837287 1.176701 0.741665
H -1.901661 -1.578472 1.047642
H -1.155548 -1.029779 -0.467173
H 1.224477 2.118753 1.253979
H 4.218218 -1.757686 -1.513876
H 2.828263 -3.464676 -0.361956
H 4.805198 0.613072 -1.929492
H 2.632017 3.782402 0.095635
H 4.429063 3.055727 -1.506968
H -3.500248 0.891981 1.812623
H -2.934444 -1.012732 -2.035538
H 1.413565 -4.361412 1.194429
H -5.751104 1.747933 1.060158
H -5.168540 -0.171252 -2.796293
H -6.586849 1.213468 -1.249882


